SCHEMBL6462883

SCHEMBL6462883

NC(=O)N(c1ccc(Cc2ccc(N(C(N)=O)S(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2)cc1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.52
NR3C1 P04150 8/20 0.51
ALOX5 P09917 2/20 0.50
SRD5A2 P31213 1/20 0.50
PGR P06401 4/20 0.48
DAGLA Q9Y4D2 1/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6467690 0.89 KMT2A (0.51) PTGESALOX5
SCHEMBL6244071 0.88 KMT2A (0.57) NR3C1
SCHEMBL6465397 0.86 CA1 (0.52) PTGESALOX5PTPN22
SCHEMBL6529186 0.85 CA1 (0.51) PTGESALOX5PTPN22
SCHEMBL8620628 0.84 TP53 (0.55) LMNA
SCHEMBL6467475 0.83 KMT2A (0.46) PTGESALOX5
SCHEMBL7102927 0.80 TP53 (0.59) PTGESNR3C1ALOX5LMNAHTT
SCHEMBL27679 0.80 LMNA (0.54) LMNA
SCHEMBL6470650 0.79 CA12 (0.50) LMNA
SCHEMBL6244082 0.79 TP53 (0.55) PTGESNR3C1ALOX5LMNAHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050255998-A1 Mixture of colour developers CIBA SPECIALTY CHEMICALS CORP. 2005-11-17 US disclosed
US-20050106491-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-05-19 US disclosed
EP-1480835-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
EP-1480836-A1 MIXTURE OF COLOUR DEVELOPERS Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
US-5612280-A AROMATIC SULFONYLUREA AND SULFONYLTHIOUREA DERIVATIVES AS COLOR DEVELOPERS; COLORFASTNESS, STORAGE STABILITY, WHITENESS NEW OJI PAPER CO., LTD. (JP) 1997-03-18 US disclosed